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1,3,6-Cyclononatriene

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1,3,6-Cyclononatriene
SpectraBase Compound ID 4m0yeH0cMJx
InChI InChI=1S/C9H12/c1-2-4-6-8-9-7-5-3-1/h1-4,7,9H,5-6,8H2/b3-1-,4-2?,9-7-
InChIKey DNRZWYGHTIEMRJ-KFIGJDPMSA-N
Mol Weight 120.19 g/mol
Molecular Formula C9H12
Exact Mass 120.0939 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E4rgrEakOE5
Name 1,3,6-Cyclononatriene
CAS Registry Number 76736-64-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H12
InChI InChI=1S/C9H12/c1-2-4-6-8-9-7-5-3-1/h1-4,7,9H,5-6,8H2/b3-1-,4-2?,9-7-
InChIKey DNRZWYGHTIEMRJ-KFIGJDPMSA-N
Instrument Name Bruker HX-90
Literature Reference L.A. Paquette, S.V. Ley, S.G. Traynor, J. Am. Chem. Soc. 98, 8162 (1976).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3